CID 482380

[(4r)-2-oxo-4-benzylazetidinyl]-n-benzamide

Structural Information

Molecular Formula
C17H16N2O2
SMILES
C1[C@H](N(C1=O)C(=O)NC2=CC=CC=C2)CC3=CC=CC=C3
InChI
InChI=1S/C17H16N2O2/c20-16-12-15(11-13-7-3-1-4-8-13)19(16)17(21)18-14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,18,21)/t15-/m1/s1
InChIKey
YEBHXKQVWFOPMF-OAHLLOKOSA-N
Compound name
(2R)-2-benzyl-4-oxo-N-phenylazetidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

280.1212 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.128476 163.2
[M+Na]+ 303.110418 168.0
[M-H]- 279.113924 170.9
[M+NH4]+ 298.155023 170.6
[M+K]+ 319.084358 167.2
[M+H-H2O]+ 263.118460 148.2
[M+HCOO]- 325.119401 184.1
[M+CH3COO]- 339.135051 203.9
[M+Na-2H]- 301.095866 167.0
[M]+ 280.12065142 170.1
[M]- 280.12174858 170.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.